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Details

Stereochemistry ACHIRAL
Molecular Formula C7H4NS2.Na
Molecular Weight 189.233
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of SODIUM 2-MERCAPTOBENZOTHIAZOLE

SMILES

[Na+].[S-]C1=NC2=C(S1)C=CC=C2

InChI

InChIKey=VLDHWMAJBNWALQ-UHFFFAOYSA-M
InChI=1S/C7H5NS2.Na/c9-7-8-5-3-1-2-4-6(5)10-7;/h1-4H,(H,8,9);/q;+1/p-1

HIDE SMILES / InChI

Molecular Formula Na
Molecular Weight 22.9898
Charge 1
Count
Stereochemistry ACHIRAL
Additional Stereochemistry No
Defined Stereocenters 0 / 0
E/Z Centers 0
Optical Activity NONE

Molecular Formula C7H5NS2
Molecular Weight 167.251
Charge 0
Count
Stereochemistry ACHIRAL
Additional Stereochemistry No
Defined Stereocenters 0 / 0
E/Z Centers 0
Optical Activity NONE

2-Mercaptobenzothiazole (MBT) can be a human carcinogen. It causes allergic contact dermatitis. For external animal use only: for Dogs, Cats and Horses it’s used to afford relief to certain common skin problems sometimes referred to as summer eczema, kennel itch, or hot spots (moist dermatitis). These conditions are characterized by intense itching and scratching, followed by rough scaly skin, and hair loss. Skin Balm relieves itching, softens the skin and helps return your animals' coat and skin to a healthy state.

Approval Year

TargetsConditions
PubMed

PubMed

TitleDatePubMed
Skin elicitation threshold of ethylbutyl thiourea and mercaptobenzothiazole with relative leaching from sensitizing products.
1994 Feb
Usefulness of patch tests for diagnosing selective allergy to captopril.
2001
Contact dermatitis in students practicing sports: incidence of rubber sensitisation.
2001 Apr
Optimization of the simultaneous batch determinations of Bi(III), Hg(II) and Cu(II) at an epoxy-graphite electrode bulk modified with 2-mercaptobenzothiazole.
2001 Dec
Modified short-term guinea pig sensitization tests for detecting contact allergens as an alternative to the conventional test.
2001 Mar
[Occupational diseases among personnel of Polish hospitals, 2001].
2002
Evaluation of CD86 expression and MHC class II molecule internalization in THP-1 human monocyte cells as predictive endpoints for contact sensitizers.
2002 Dec
High-pressure Fourier transform micro-Raman spectroscopic investigation of diiodine-heterocyclic thioamide adducts.
2002 Oct
Synthesis, structural characterization and in vitro cytotoxicity of organotin(IV) derivatives of heterocyclic thioamides, 2-mercaptobenzothiazole, 5-chloro-2-mercaptobenzothiazole, 3-methyl-2-mercaptobenzothiazole and 2-mercaptonicotinic acid.
2003 Aug 1
Common shoe allergens undetected by commercial patch-testing kits: dithiodimorpholine and isocyanates.
2003 Jun
Studies in polyphenol chemistry and bioactivity. 4.(1) Synthesis of trimeric, tetrameric, pentameric, and higher oligomeric epicatechin-derived procyanidins having all-4beta,8-interflavan connectivity and their inhibition of cancer cell growth through cell cycle arrest.
2003 Mar 7
Homolytic cleavage and aggregation processes in cyclopentadienylchromium chemistry.
2004 Mar
Determination of 2-mercaptobenzothiazole (MBT) in tannery wastewater by high performance liquid chromatography with amperometric detection.
2004 Nov
Pressure-tuning Raman spectra of diiodine thioamide compounds: models for antithyroid drug activity.
2006
Mercaptobenzothiazole or the mercapto-mix: which should be in the standard series?
2006 Jul
Prediction of estrogen receptor agonists and characterization of associated molecular descriptors by statistical learning methods.
2006 Nov
Respective contributions of polar vs enthalpy effects in the addition/fragmentation of mercaptobenzoxazole-derived thiyl radicals and analogues to double bonds.
2006 Oct 19
Predicting the efficiencies of 2-mercaptobenzothiazole collectors used as chelating agents in flotation processes: a density-functional study.
2006 Sep
Fmoc-2-mercaptobenzothiazole, for the introduction of the Fmoc moiety free of side-reactions.
2007
Zebrafish as a new model for phenotype-based screening of melanogenic regulatory compounds.
2007 Apr
Comparison of the adsorption orientation for 2-mercaptobenzothiazole and 2-mercaptobenzoxazole by SERS spectroscopy.
2007 Dec 31
Synthesis, structural characterization, and biological studies of six- and five-coordinate organotin(IV) complexes with the thioamides 2-mercaptobenzothiazole, 5-chloro-2-mercaptobenzothiazole, and 2-mercaptobenzoxazole.
2007 Feb 19
Structural identification and characterization of impurities in ceftizoxime sodium.
2007 Jan 17
Cross-reactions between xanthates and rubber additives.
2007 Sep
Epidemio-allergological study in 155 cases of footwear dermatitis.
2007 Sep-Oct
Patch testing experience with 1000 patients.
2007 Sep-Oct
Predicting the binding capability of benzothiazoline-2-thione and its derivatives with gold: a DFT and FT-Raman combined studies.
2008 Dec 15
Photodegradation of 2-mercaptobenzothiazole in the gamma-Fe(2)O(3)/oxalate suspension under UVA light irradiation.
2008 May 1
Reactivity of in vitro activated human T lymphocytes to p-phenylenediamine and related substances.
2008 Oct
Structural motifs of diiodine complexes with amides and thioamides.
2008 Oct 14
Re-creation of historical chrysotile-containing joint compounds.
2008 Sep
Patents

Sample Use Guides

Rabbits: the dermal LD50 value (the dose resulting in 50% mortality in the exposed animals) for the rabbit has been reported to be greater than 5010 mg/kg Rats: Oral LD50: 2100 mg/kg
Route of Administration: Other
At an in vitro concentration of 1mM mercaptobenzothiazole caused a slow inhibition of the hexose monophosphate pathway and a moderate stimulation of the tricarboxylic acid cycle of Ehrlich ascites tumor cells.
Substance Class Chemical
Created
by admin
on Sat Dec 16 05:14:52 GMT 2023
Edited
by admin
on Sat Dec 16 05:14:52 GMT 2023
Record UNII
2K7B30DX7O
Record Status Validated (UNII)
Record Version
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Name Type Language
SODIUM 2-MERCAPTOBENZOTHIAZOLE
HSDB  
Systematic Name English
DUODEX
Brand Name English
SANBIT N-G
Brand Name English
SODIUM 2-MERCAPTOBENZOTHIAZOLE [HSDB]
Common Name English
2(3H)-BENZOTHIAZOLETHIONE, SODIUM SALT (1:1)
Common Name English
NSC-191935
Code English
NACAP
Brand Name English
SODIUM MBT
Common Name English
SODIUM 2-MERCAPTOBENZOTHIOLATE
Common Name English
Classification Tree Code System Code
EPA PESTICIDE CODE 51704
Created by admin on Sat Dec 16 05:14:52 GMT 2023 , Edited by admin on Sat Dec 16 05:14:52 GMT 2023
Code System Code Type Description
ECHA (EC/EINECS)
219-660-8
Created by admin on Sat Dec 16 05:14:52 GMT 2023 , Edited by admin on Sat Dec 16 05:14:52 GMT 2023
PRIMARY
EPA CompTox
DTXSID1026035
Created by admin on Sat Dec 16 05:14:52 GMT 2023 , Edited by admin on Sat Dec 16 05:14:52 GMT 2023
PRIMARY
NSC
191935
Created by admin on Sat Dec 16 05:14:52 GMT 2023 , Edited by admin on Sat Dec 16 05:14:52 GMT 2023
PRIMARY
FDA UNII
2K7B30DX7O
Created by admin on Sat Dec 16 05:14:52 GMT 2023 , Edited by admin on Sat Dec 16 05:14:52 GMT 2023
PRIMARY
CAS
2492-26-4
Created by admin on Sat Dec 16 05:14:52 GMT 2023 , Edited by admin on Sat Dec 16 05:14:52 GMT 2023
PRIMARY
HSDB
6141
Created by admin on Sat Dec 16 05:14:52 GMT 2023 , Edited by admin on Sat Dec 16 05:14:52 GMT 2023
PRIMARY
PUBCHEM
3714831
Created by admin on Sat Dec 16 05:14:52 GMT 2023 , Edited by admin on Sat Dec 16 05:14:52 GMT 2023
PRIMARY
DRUG BANK
DBSALT002839
Created by admin on Sat Dec 16 05:14:52 GMT 2023 , Edited by admin on Sat Dec 16 05:14:52 GMT 2023
PRIMARY
CFR
21 CFR 176.300
Created by admin on Sat Dec 16 05:14:52 GMT 2023 , Edited by admin on Sat Dec 16 05:14:52 GMT 2023
PRIMARY
Related Record Type Details
PARENT -> SALT/SOLVATE